4(3H)-Quinazolinone, 3-(3-chloro-4-methoxyphenyl)-2-methyl-, hydrochloride
Basic information
- CAS
3060-25-1- Standard SMILES
COc1ccc(-n2c(C)nc3ccccc3c2=O)cc1Cl.Cl- InChIKey
XGMOJELKOCZTLW-UHFFFAOYSA-N- Molecular formula
- C16H14Cl2N2O2
- Average molar mass
- 337.2 g/mol
- Monoisotopic mass
- 336.0432331
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(3-chloro-4-methoxyphenyl)-2-methyl-, hydrochloride
- IUPAC
- 3-(3-chloro-4-methoxyphenyl)-2-methylquinazolin-4-one;hydrochloride
Names & synonyms
CHI 154(3H)-Quinazolinone, 3-(3-chloro-4-methoxyphenyl)-2-methyl-, hydrochloride3060-25-1DTXSID401846712-Methyl-3-(4'-methoxy-5-chlorphenyl)chinazolon-4 hydrochloride [German]4(3H)-Quinazolinone, 3-(3-chloro-4-anisyl)-2-methyl-, hydrochloride2-Methyl-3-(4'-methoxy-5-chlorphenyl)chinazolon-4 hydrochlorideRefChem:284042DTXCID801071623-(3-Chloro-4-methoxyphenyl)-2-methylquinazolin-4(3H)-one--hydrogen chloride (1/1)
Database identifiers
- CAS
3060-25-1- PubChem CID
- 63379
- DTXSID
DTXSID40184671
Properties
Computed structural properties
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 440
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Compound notes
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